[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 3-methoxy-4-prop-2-enoxy-benzoate

Systemtic Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 3-methoxy-4-prop-2-enoxy-benzoate Openeye Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 4-allyloxy-3-methoxy-benzoate CAS Name: 3-methoxy-4-prop-2-enoxybenzoic acid [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 3-methoxy-4-prop-2-enoxybenzoate Traditional Name: 4-allyloxy-3-methoxy-benzoic acid [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C20H17BrN2O5 MolecularWeight: 445.26338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OCC2=NC(=NO2)C3=CC(=CC=C3)Br)OCC=C

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OCC2=NC(=NO2)C3=CC(=CC=C3)Br)OCC=C

InChI

InChI=1S/C20H17BrN2O5/c1-3-9-26-16-8-7-14(11-17(16)25-2)20(24)27-12-18-22-19(23-28-18)13-5-4-6-15(21)10-13/h3-8,10-11H,1,9,12H2,2H3